SCHEMBL10693653

SCHEMBL10693653

Nc1ccc(Nc2ccc(S(=O)(=O)O)c(N)c2)c(S(=O)(=O)CCS(=O)(=O)O)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAPGEF4 Q8WZA2 1/20 0.59
ALDH1A1 P00352 3/20 0.54
KDM4E B2RXH2 2/20 0.54
POLB P06746 2/20 0.54
GAA P10253 2/20 0.54
MAPT P10636 2/20 0.54
RECQL P46063 2/20 0.54
CASP6 P55212 2/20 0.54
TDP1 Q9NUW8 2/20 0.54
L3MBTL1 Q9Y468 2/20 0.54
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54
ELAVL1 Q15717 1/20 0.54
APEX1 P27695 2/20 0.53
NSD2 O96028 1/20 0.53
APOBEC3A P31941 1/20 0.53
APOBEC3G Q9HC16 1/20 0.53
NT5E P21589 1/20 0.50
HSD17B10 Q99714 3/20 0.42
GNG2 P59768 5/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL10693431 0.90 RAPGEF4 (0.59) RAPGEF4ALDH1A1KDM4EPOLBGAA
SCHEMBL10696297 0.87 RAPGEF4 (0.68) RAPGEF4ALDH1A1KDM4EPOLBGAA
SCHEMBL9155347 0.87 RAPGEF4 (0.77) RAPGEF4ALDH1A1KDM4EPOLBGAA
SCHEMBL10347247 0.84 RAPGEF4 (0.53) RAPGEF4ALDH1A1KDM4EPOLBGAA
SCHEMBL10693454 0.84 TDP1 (0.57) RAPGEF4ALDH1A1KDM4EPOLBGAA
SCHEMBL10347196 0.82 RAPGEF4 (0.65) RAPGEF4ALDH1A1KDM4EPOLBGAA
SCHEMBL17774696 0.81 RAPGEF4 (0.59) RAPGEF4ALDH1A1KDM4EPOLBGAA
SCHEMBL10388837 0.79 L3MBTL1 (0.50) RAPGEF4ALDH1A1KDM4EPOLBGAA
SCHEMBL10389480 0.79 RAPGEF4 (0.48) RAPGEF4ALDH1A1KDM4EPOLBGAA
SCHEMBL10388839 0.79 RAPGEF4 (0.48) RAPGEF4ALDH1A1KDM4EPOLBGAA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4785099-A FIBER-REACTIVE DYES FOR CELLULOSE HOECHST AKTIENGESELLSCHAFT (DE) 1988-11-15 US disclosed